Geometry & MOs

Info

ID:	240618
PubChem CID:	93616781
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	316.089306
ΔH_f, kcal/mol:	-95.84
Dipole, Da:	3.26
IP(EA), eV:	-8.88(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-methoxy-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)N[C@H](C)C(C)C)C(=O)N

DOS

IR

Vibrations