Geometry & MOs

Info

ID:	73619
PubChem CID:	48419522
Reduced:	ClO2N4C11H13 (1)
Stoich.:	AB2C4D11E13 (1)
Weight, g/mol:	258.148061
ΔH_f, kcal/mol:	1.02
Dipole, Da:	2.37
IP(EA), eV:	-8.76(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[benzyl(methyl)amino]-N-(1-methylpyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1CCC(=O)NC2=CN(N=C2)C)Cl

DOS

IR

Vibrations