Geometry & MOs

Info

ID:	340597
PubChem CID:	127262608
Reduced:	SN2O4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	230.163043
ΔH_f, kcal/mol:	-118.15
Dipole, Da:	3.81
IP(EA), eV:	-8.61(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-(3-amino-2-hydroxycyclohexyl)carbamate

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations