Geometry & MOs

Info

ID:	197073
PubChem CID:	78918424
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	294.137971
ΔH_f, kcal/mol:	-5.3
Dipole, Da:	5.28
IP(EA), eV:	-8.69(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[(3-fluorophenyl)carbamoyl]piperidine-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)[N+](=O)[O-])NC(C)CN2CCCC2

DOS

IR

Vibrations