Geometry & MOs

Info

ID:	205288
PubChem CID:	80080599
Reduced:	N3C13H17 (1)
Stoich.:	A3B13C17 (1)
Weight, g/mol:	233.098669
ΔH_f, kcal/mol:	61.91
Dipole, Da:	5.37
IP(EA), eV:	-8.55(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,4-dimethyl-2-N-(1,3-thiazol-4-ylmethyl)benzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N)N(CCC#N)C2CC2

DOS

IR

Vibrations