Geometry & MOs

Info

ID:	248013
PubChem CID:	103078200
Reduced:	ON5C9H17 (1)
Stoich.:	AB5C9D17 (1)
Weight, g/mol:	223.179696
ΔH_f, kcal/mol:	-1.49
Dipole, Da:	6.18
IP(EA), eV:	-8.18(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(1-ethylpiperidin-3-yl)-1-methylpyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C)NC1=NN(C=C1N)C

DOS

IR

Vibrations