Geometry & MOs

Info

ID:	248037
PubChem CID:	103078430
Reduced:	N5C10H19 (1)
Stoich.:	A5B10C19 (1)
Weight, g/mol:	242.077931
ΔH_f, kcal/mol:	40.81
Dipole, Da:	1.63
IP(EA), eV:	-7.63(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-(3,4,5-trifluorophenyl)pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)NCCN2CCCC2)N

DOS

IR

Vibrations