Geometry & MOs

Info

ID:	199233
PubChem CID:	79221469
Reduced:	NOSC16H23 (1)
Stoich.:	ABCD16E23 (1)
Weight, g/mol:	219.108171
ΔH_f, kcal/mol:	-46.72
Dipole, Da:	2.07
IP(EA), eV:	-8.39(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzothiophen-3-ylmethyl)-2-methylcyclopropan-1-amine

Drug info:

PubChemData

Smile

C1CCC(C(C1)CNCC2CSC3=CC=CC=C23)O

DOS

IR

Vibrations