Geometry & MOs

Info

ID:	350756
PubChem CID:	127279044
Reduced:	FN2O2C16H19 (1)
Stoich.:	AB2C2D16E19 (1)
Weight, g/mol:	261.118735
ΔH_f, kcal/mol:	-136.14
Dipole, Da:	6.78
IP(EA), eV:	-9.07(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1-benzothiophen-2-yl-(2,2-dimethylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)C2CC(=O)NC3=C2C=CC(=C3)F)C

DOS

IR

Vibrations