Geometry & MOs

Info

ID:

215250

PubChem CID:

85084426

Reduced:

SeSiO5C44H60 (1)

Stoich.:

ABC5D44E60 (1)

Weight, g/mol:

613.1536

ΔHf, kcal/mol:

-263.12

Dipole, Da:

2.37

IP(EA), eV:

 -8.37(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 4-[amino(methyl)carbamoyl]oxy-8-(bromomethyl)-6-[3-[3-(dimethylamino)-4-methoxyphenyl]prop-2-enoyl]-2-methyl-7,8-dihydro-3H-pyrrolo[3,2-e]indole-1-carboxylate

Drug info:

PubChemData

Smile

CC1CC(C2C(C(C(C=C2C1O)[Se]C3=CC=CC=C3)C)CCC4CC(OC(O4)(C)C)CCO[Si](C5=CC=CC=C5)(C6=CC=CC=C6)C(C)(C)C)O

DOS

IR

Vibrations