Geometry & MOs

Info

ID:	22792
PubChem CID:	598743
Reduced:	ClON2C21H21 (1)
Stoich.:	ABC2D21E21 (1)
Weight, g/mol:	352.134241
ΔH_f, kcal/mol:	-7.4
Dipole, Da:	3.56
IP(EA), eV:	-8.62(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloro-4-methylanilino)-1-(1,2,3,4-tetrahydrocarbazol-9-yl)ethanone

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NCC(=O)N2C3=C(CCCC3)C4=CC=CC=C42)Cl

DOS

IR

Vibrations