Geometry & MOs

Info

ID:	269361
PubChem CID:	103617167
Reduced:	ClNSC15H18 (1)
Stoich.:	ABCD15E18 (1)
Weight, g/mol:	279.084849
ΔH_f, kcal/mol:	28.7
Dipole, Da:	2.45
IP(EA), eV:	-9.06(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chlorothiophen-2-yl)-N-[(3,4-dimethylphenyl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)CNCCC2=CC=C(S2)Cl)C

DOS

IR

Vibrations