Geometry & MOs

Info

ID:	248042
PubChem CID:	103078473
Reduced:	N4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	208.093581
ΔH_f, kcal/mol:	60.22
Dipole, Da:	3.31
IP(EA), eV:	-7.69(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-(3,3,3-trifluoropropyl)pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1)NC2=NN(C=C2N)C

DOS

IR

Vibrations