Geometry & MOs

Info

ID:	280627
PubChem CID:	103850365
Reduced:	SN2O2C7H12 (1)
Stoich.:	AB2C2D7E12 (1)
Weight, g/mol:	201.136493
ΔH_f, kcal/mol:	-39.23
Dipole, Da:	7.27
IP(EA), eV:	-10.01(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(3-hydroxybutyl)-N-methyloxolane-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC=C)S(=O)(=O)CC#N

DOS

IR

Vibrations