Geometry & MOs

Info

ID:	198006
PubChem CID:	79031803
Reduced:	NOC16H19 (1)
Stoich.:	ABC16D19 (1)
Weight, g/mol:	233.189198
ΔH_f, kcal/mol:	-14.38
Dipole, Da:	2.86
IP(EA), eV:	-9.34(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-cyclopropyl-5-methyl-2-N-(3-methylbutyl)pyridine-2,3-diamine

Drug info:

PubChemData

Smile

CCC(CC1=CC=CC=C1)(C2=C(C=CN=C2)C)O

DOS

IR

Vibrations