Geometry & MOs

Info

ID:	423221
PubChem CID:	135119134
Reduced:	ON2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	398.125355
ΔH_f, kcal/mol:	-50.48
Dipole, Da:	8.68
IP(EA), eV:	-8.86(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-2-(1,1,2,2-tetrafluoroethoxy)benzamide

Drug info:

PubChemData

Smile

CC(CCN(C)C1=NC(=CN=C1)C(=O)O)N2CCCC2

DOS

IR

Vibrations