Geometry & MOs

Info

ID:	179908
PubChem CID:	76553744
Reduced:	O3N6C26H26 (1)
Stoich.:	A3B6C26D26 (1)
Weight, g/mol:	446.206639
ΔH_f, kcal/mol:	-42.22
Dipole, Da:	6.72
IP(EA), eV:	-8.34(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-N-(1-carbamoylindol-3-yl)-2-N-(1-phenylcyclopropyl)pyrrolidine-1,2-dicarboxamide

Drug info:

PubChemData

Smile

C1C(CN(C1C(=O)NCC2=CC3=CC=CC=C3C=C2)C(=O)NC4=CN(C5=CC=CC=C54)C(=O)N)N

DOS

IR

Vibrations