Geometry & MOs

Info

ID:	310294
PubChem CID:	126578171
Reduced:	O4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	270.194343
ΔH_f, kcal/mol:	-172.5
Dipole, Da:	1.36
IP(EA), eV:	-9.64(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[acetyl(methyl)amino]cyclohexyl]carbamate

Drug info:

PubChemData

Smile

C1C(CC2COCC1C2O)CC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations