Geometry & MOs

Info

ID:	188431
PubChem CID:	77716764
Reduced:	OCl2N2C32H36 (1)
Stoich.:	AB2C2D32E36 (1)
Weight, g/mol:	473.187005
ΔH_f, kcal/mol:	-2.56
Dipole, Da:	2.43
IP(EA), eV:	-8.77(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(4-chloro-2,7-dimethyl-1H-indol-3-yl)acetyl]amino]-N-methyl-N,3-diphenylpropanamide

Drug info:

PubChemData

Smile

CCC(C1(CCCN(C1)C(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl)N4CCC(CC4)C5=CC=CC=C5

DOS

IR

Vibrations