Geometry & MOs

Info

ID:	248075
PubChem CID:	103078709
Reduced:	SN4C10H14 (1)
Stoich.:	AB4C10D14 (1)
Weight, g/mol:	176.087353
ΔH_f, kcal/mol:	66.53
Dipole, Da:	3.11
IP(EA), eV:	-8.28(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(2,2-difluoroethyl)-1-methylpyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CNC2=NN(C=C2N)C

DOS

IR

Vibrations