Geometry & MOs

Info

ID:	46331
PubChem CID:	10523915
Reduced:	OSN3C22H27 (1)
Stoich.:	ABC3D22E27 (1)
Weight, g/mol:	381.143236
ΔH_f, kcal/mol:	10.9
Dipole, Da:	6.32
IP(EA), eV:	-8.42(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-thiophen-2-yl-1-(3,4,5-trimethoxyphenyl)sulfanylpentan-3-amine

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2C(=S)NC(C23CCCC3)NCC4=CC=CC=C4

DOS

IR

Vibrations