Geometry & MOs

Info

ID:	352873
PubChem CID:	127283963
Reduced:	O3N4C10H14 (1)
Stoich.:	A3B4C10D14 (1)
Weight, g/mol:	251.138225
ΔH_f, kcal/mol:	-71.12
Dipole, Da:	4.3
IP(EA), eV:	-9.64(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylpyrazol-3-yl)-2-methyl-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NC2=NOC(=C2)C

DOS

IR

Vibrations