Geometry & MOs

Info

ID:	251028
PubChem CID:	103100955
Reduced:	O2N3C12H17 (1)
Stoich.:	A2B3C12D17 (1)
Weight, g/mol:	253.153875
ΔH_f, kcal/mol:	-78.19
Dipole, Da:	2.07
IP(EA), eV:	-8.58(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2-amino-2-oxoethyl)-N-ethyl-5-propan-2-yl-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)CC1=CC=C(C=C1)N

DOS

IR

Vibrations