Geometry & MOs

Info

ID:	163376
PubChem CID:	57900234
Reduced:	ClSN4O4C27H27 (1)
Stoich.:	ABC4D4E27F27 (1)
Weight, g/mol:	448.166604
ΔH_f, kcal/mol:	-88.13
Dipole, Da:	2.93
IP(EA), eV:	-9.04(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminophenyl)-1-[2-(3-chlorophenyl)ethylcarbamoylamino]-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=CC2=C(C=C1)C3=C(CCO2)C=C(S3)C(=O)N(C)C4=C(C=C(C=C4)C(=O)N5CCNCC5)Cl

DOS

IR

Vibrations