Geometry & MOs

Info

ID:	276877
PubChem CID:	103825530
Reduced:	ON2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	252.158626
ΔH_f, kcal/mol:	-53.2
Dipole, Da:	4.62
IP(EA), eV:	-9.31(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=CC2=C(C=C1)N=CN2)C(=O)NC

DOS

IR

Vibrations