Geometry & MOs

Info

ID:	248071
PubChem CID:	103078683
Reduced:	ON5C10H17 (1)
Stoich.:	AB5C10D17 (1)
Weight, g/mol:	238.215747
ΔH_f, kcal/mol:	15.01
Dipole, Da:	6.18
IP(EA), eV:	-8.05(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-(2-methylpropyl)-3-N-pentan-3-ylpyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)NCCC(=O)NC2CC2)N

DOS

IR

Vibrations