Geometry & MOs

Info

ID:	251025
PubChem CID:	103100930
Reduced:	N3O3C12H17 (1)
Stoich.:	A3B3C12D17 (1)
Weight, g/mol:	239.138225
ΔH_f, kcal/mol:	-106.03
Dipole, Da:	2.86
IP(EA), eV:	-8.59(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2-amino-2-oxoethyl)-N,2-diethylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=C(C(=CC=C1)N)OC

DOS

IR

Vibrations