Geometry & MOs

Info

ID:	278549
PubChem CID:	103836463
Reduced:	NSO3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	231.183444
ΔH_f, kcal/mol:	-109.78
Dipole, Da:	6.07
IP(EA), eV:	-9.81(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(2-hydroxyethyl)pentyl]carbamate

Drug info:

PubChemData

Smile

CCCC(CCO)CNS(=O)(=O)/C=C/C1=CC=CC=C1

DOS

IR

Vibrations