Geometry & MOs

Info

ID:	253488
PubChem CID:	103118727
Reduced:	O3N5C9H15 (1)
Stoich.:	A3B5C9D15 (1)
Weight, g/mol:	295.110296
ΔH_f, kcal/mol:	-87.25
Dipole, Da:	8.13
IP(EA), eV:	-10.06(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxothiolan-3-yl)-4-methyl-5-(1-methylpyrazol-3-yl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC(=O)NCCN1C(=C(N=N1)C(=O)O)CCN

DOS

IR

Vibrations