Geometry & MOs

Info

ID:	71051
PubChem CID:	48414223
Reduced:	O2N4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	-42.8
Dipole, Da:	2.41
IP(EA), eV:	-9.54(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzamido-4-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CNC(=O)C2CC2

DOS

IR

Vibrations