Geometry & MOs

Info

ID:	71060
PubChem CID:	48414234
Reduced:	O2N4C13H20 (1)
Stoich.:	A2B4C13D20 (1)
Weight, g/mol:	312.158626
ΔH_f, kcal/mol:	-71.87
Dipole, Da:	4.05
IP(EA), eV:	-9.79(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-methylcyclopropanecarbonyl)amino]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)CNC(=O)C2CCCC2

DOS

IR

Vibrations