Geometry & MOs

Info

ID:	30377
PubChem CID:	841224
Reduced:	FNOC18H20 (1)
Stoich.:	ABCD18E20 (1)
Weight, g/mol:	288.097088
ΔH_f, kcal/mol:	-71.87
Dipole, Da:	3.06
IP(EA), eV:	-9.3(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-4-nitro-N-(pyridin-2-ylmethylideneamino)pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)[C@H](C)NC(=O)CC2=CC=C(C=C2)F

DOS

IR

Vibrations