Geometry & MOs

Info

ID:	286665
PubChem CID:	104179651
Reduced:	FNO2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	316.218449
ΔH_f, kcal/mol:	-116.44
Dipole, Da:	3.82
IP(EA), eV:	-9.25(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-(3-ethylsulfanylpropylamino)cyclohexyl]carbamate

Drug info:

PubChemData

Smile

COCC(CCO)NC1CC(C1)C2=CC=C(C=C2)F

DOS

IR

Vibrations