Geometry & MOs

Info

ID:	208369
PubChem CID:	80526096
Reduced:	S2N3C15H17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	261.129969
ΔH_f, kcal/mol:	58.63
Dipole, Da:	1.77
IP(EA), eV:	-8.04(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2,3-diamine

Drug info:

PubChemData

Smile

CC(C)(CNC1=NC2=C(S1)C=C(C=C2)N)C3=CC=CS3

DOS

IR

Vibrations