Geometry & MOs

Info

ID:	263561
PubChem CID:	103378408
Reduced:	SO2N4C14H18 (1)
Stoich.:	AB2C4D14E18 (1)
Weight, g/mol:	274.125218
ΔH_f, kcal/mol:	-39.2
Dipole, Da:	2.23
IP(EA), eV:	-8.76(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-(1-methylpyrrolidin-3-yl)-4-phenyl-1,2-thiazole-3,5-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCC(C)NC2=C(C(=NS2)N)C(=O)N

DOS

IR

Vibrations