Geometry & MOs

Info

ID:	240774
PubChem CID:	93617457
Reduced:	SN2O4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	336.114378
ΔH_f, kcal/mol:	-151.63
Dipole, Da:	6.79
IP(EA), eV:	-9.59(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]-N-[(4-methylphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)NC(=O)[C@H](C)S(=O)(=O)CC2=NOC(=C2)C

DOS

IR

Vibrations