Geometry & MOs

Info

ID:	276150
PubChem CID:	103820957
Reduced:	SN2O2C17H28 (1)
Stoich.:	AB2C2D17E28 (1)
Weight, g/mol:	326.256943
ΔH_f, kcal/mol:	-102.78
Dipole, Da:	4.01
IP(EA), eV:	-8.85(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[(1-hydroxy-4,4-dimethylcyclohexyl)methylamino]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCCC(C1=CC=CS1)NC2CCN(C2)C(=O)OC(C)(C)C

DOS

IR

Vibrations