Geometry & MOs

Info

ID:	245363
PubChem CID:	99443873
Reduced:	FNO2C22H24 (1)
Stoich.:	ABC2D22E24 (1)
Weight, g/mol:	446.167557
ΔH_f, kcal/mol:	-58.67
Dipole, Da:	4.58
IP(EA), eV:	-8.74(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[(1R)-1-(2-fluorophenyl)ethyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)/C=C/C(=O)N(C2CC2)[C@@H](C)C3=CC=CC=C3F

DOS

IR

Vibrations