Geometry & MOs

Info

ID:

278452

PubChem CID:

103835828

Reduced:

SN2O3C14H28 (1)

Stoich.:

AB2C3D14E28 (1)

Weight, g/mol:

229.167794

ΔHf, kcal/mol:

-166.76

Dipole, Da:

3.91

IP(EA), eV:

-9.52(0.06)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

tert-butyl N-[(3-hydroxycyclohexyl)methyl]carbamate

Drug info:

PubChemData

Smile

CC1CC(CN(C1)S(=O)(=O)NCC2CCCC(C2)O)C

DOS

IR

Vibrations