Geometry & MOs

Info

ID:	420638
PubChem CID:	135114525
Reduced:	SN2O2C16H22 (1)
Stoich.:	AB2C2D16E22 (1)
Weight, g/mol:	379.120192
ΔH_f, kcal/mol:	-73.46
Dipole, Da:	4.61
IP(EA), eV:	-9.1(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-5-phenyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2(CCN(CC2)C(=O)CC3=CSC(=N3)C)OCC1

DOS

IR

Vibrations