Geometry & MOs

Info

ID:	401695
PubChem CID:	135052151
Reduced:	ClO3N4H19C22 (1)
Stoich.:	AB3C4D19E22 (1)
Weight, g/mol:	370.109962
ΔH_f, kcal/mol:	31.8
Dipole, Da:	5.1
IP(EA), eV:	-8.35(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-acetyl-3-benzyltriazol-4-yl)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC(=O)/C(=C(\C2=CC=C(C=C2)Cl)/NNC3=CC=CC=C3)/N=O

DOS

IR

Vibrations