Geometry & MOs

Info

ID:

169885

PubChem CID:

75161457

Reduced:

ON2C10H14 (3)

Stoich.:

AB2C10D14 (3)

Weight, g/mol:

1524.927289

ΔHf, kcal/mol:

-83.13

Dipole, Da:

5.69

IP(EA), eV:

-8.28(0.05)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[6-[[6-amino-1-[[7-[[1-[[1-[[1-[[1-[[1-[[1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-6-oxoheptyl]amino]-1-oxohexan-2-yl]amino]-6-oxohexyl]-5-(2-aminopyrimidin-4-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2CCN(CC2)CC3CC(=O)NC(N3)N4CCN(CC4)C(=O)COCC5=CC=CC=C5)C

DOS

IR

Vibrations