Geometry & MOs

Info

ID:	78553
PubChem CID:	49693601
Reduced:	ClS2N3O4C14H16 (1)
Stoich.:	AB2C3D4E14F16 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-80.14
Dipole, Da:	7.36
IP(EA), eV:	-9.32(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methyl-1,2-oxazol-5-yl)-2-(4-propan-2-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=C(S3)Cl

DOS

IR

Vibrations