Geometry & MOs

Info

ID:	248102
PubChem CID:	103078950
Reduced:	N5C11H21 (1)
Stoich.:	A5B11C21 (1)
Weight, g/mol:	237.195346
ΔH_f, kcal/mol:	34.62
Dipole, Da:	2.78
IP(EA), eV:	-7.76(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-[2-(1-methylpiperidin-4-yl)ethyl]pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CC1CN(CCC1NC2=NN(C=C2N)C)C

DOS

IR

Vibrations