Geometry & MOs

Info

ID:	396585
PubChem CID:	135028802
Reduced:	NO2H13C17 (1)
Stoich.:	AB2C13D17 (1)
Weight, g/mol:	232.132411
ΔH_f, kcal/mol:	-2.4
Dipole, Da:	4.2
IP(EA), eV:	-8.76(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5,6-dimethylbenzotriazol-1-yl)methyl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)NC=C2C(=O)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations