Geometry & MOs

Info

ID:	31602
PubChem CID:	855922
Reduced:	ON3C20H31 (1)
Stoich.:	AB3C20D31 (1)
Weight, g/mol:	300.077789
ΔH_f, kcal/mol:	-25.02
Dipole, Da:	3.63
IP(EA), eV:	-7.95(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzotriazol-1-yl)-N-(3-chloro-4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)N=C(CN2CCCCC2)N3CCCCC3

DOS

IR

Vibrations