Geometry & MOs

Info

ID:	417256
PubChem CID:	135091799
Reduced:	SN2O3C20H24 (1)
Stoich.:	AB2C3D20E24 (1)
Weight, g/mol:	302.108899
ΔH_f, kcal/mol:	-84.87
Dipole, Da:	6.35
IP(EA), eV:	-8.95(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-2-thiophen-2-ylacetamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C3(CCN(CC3)C(=O)NCC4=CC=CS4)OCC2

DOS

IR

Vibrations