Geometry & MOs

Info

ID:	199240
PubChem CID:	79222290
Reduced:	SN2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	274.15037
ΔH_f, kcal/mol:	5.73
Dipole, Da:	2.2
IP(EA), eV:	-8.46(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCNCC1CCCN(C1)CCSC2=CC=CC=C2

DOS

IR

Vibrations