Geometry & MOs

Info

ID:	174473
PubChem CID:	75767392
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	300.158626
ΔH_f, kcal/mol:	-11.09
Dipole, Da:	4.56
IP(EA), eV:	-8.34(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzamido-N-butan-2-yl-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC(=O)CCN2C3=C(C=C(C=C3)OC)C=N2

DOS

IR

Vibrations