Geometry & MOs

Info

ID:	240761
PubChem CID:	93617373
Reduced:	NSO5C14H19 (1)
Stoich.:	ABC5D14E19 (1)
Weight, g/mol:	339.114044
ΔH_f, kcal/mol:	-195.86
Dipole, Da:	7.4
IP(EA), eV:	-9.09(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(5-acetyl-2-methoxyphenyl)methylsulfonyl]-N-cyclopropylpropanamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC)S(=O)(=O)CC1=C(C=CC(=C1)C(=O)C)OC

DOS

IR

Vibrations