Geometry & MOs

Info

ID:	190458
PubChem CID:	78008293
Reduced:	N2O4H34C35 (1)
Stoich.:	A2B4C34D35 (1)
Weight, g/mol:	506.212491
ΔH_f, kcal/mol:	-89.58
Dipole, Da:	3.09
IP(EA), eV:	-8.31(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-chloro-2-methylphenyl)ethyl]-2,3-dimethyl-1-[(4-phenylphenyl)methyl]indole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C)NC(=O)C2=CC3=C(C=C2)N(C(=C3C)C)CC4=CC=C(C=C4)C5=CC=CC=C5C(=O)O)OC

DOS

IR

Vibrations