Geometry & MOs

Info

ID:	76913
PubChem CID:	48425564
Reduced:	NOC5H9 (3)
Stoich.:	ABC5D9 (3)
Weight, g/mol:	224.127326
ΔH_f, kcal/mol:	-167.76
Dipole, Da:	6.59
IP(EA), eV:	-9.32(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)N1CCCC(C1)C(=O)NCC(=O)N(CC)CC

DOS

IR

Vibrations