Geometry & MOs

Info

ID:

180353

PubChem CID:

76620172

Reduced:

F5N14O17C54H79 (1)

Stoich.:

A5B14C17D54E79 (1)

Weight, g/mol:

510.272987

ΔHf, kcal/mol:

-947.65

Dipole, Da:

3.04

IP(EA), eV:

 -9.65(-1.4)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[[2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylpentanoyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoate

Drug info:

PubChemData

Smile

CCC(C)C(C(=O)NC(C(C)O)C(=O)NCC(=O)NC(C(C(=O)N)O)C(=O)NC(CO)C(=O)NCC(C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)NC(=O)OCC2=CC=CC=C2)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(C(C(C)C)O)N

DOS

IR

Vibrations