Geometry & MOs

Info

ID:	39787
PubChem CID:	8142284
Reduced:	NF2O2H17C21 (1)
Stoich.:	AB2C2D17E21 (1)
Weight, g/mol:	331.157229
ΔH_f, kcal/mol:	-102.54
Dipole, Da:	3.23
IP(EA), eV:	-8.97(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(R)-(4-methoxyphenyl)-phenylmethyl]-3-methylbenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@@H](C2=CC=CC=C2)NC(=O)C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations