Geometry & MOs

Info

ID:	312276
PubChem CID:	126604047
Reduced:	OPSC12H27 (1)
Stoich.:	ABCD12E27 (1)
Weight, g/mol:	484.23735
ΔH_f, kcal/mol:	-104.79
Dipole, Da:	2.46
IP(EA), eV:	-8.5(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R)-1-(2-fluoro-6-methylbenzoyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]piperidine-3-carboxylate

Drug info:

PubChemData

Smile

CC(CC(C)(C)C)OSC(C)(C)CPC

DOS

IR

Vibrations