Geometry & MOs

Info

ID:	149996
PubChem CID:	53789679
Reduced:	OC12H18 (1)
Stoich.:	AB12C18 (1)
Weight, g/mol:	417.309038
ΔH_f, kcal/mol:	-56.86
Dipole, Da:	2.48
IP(EA), eV:	-9.13(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(4S,5S,6S)-5,6-dihydroxy-2,9-dimethyldecan-4-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1)C(C)(C)O

DOS

IR

Vibrations