Geometry & MOs

Info

ID:	127669
PubChem CID:	51010639
Reduced:	FNOC22H26 (1)
Stoich.:	ABCD22E26 (1)
Weight, g/mol:	287.115758
ΔH_f, kcal/mol:	-58.95
Dipole, Da:	2.44
IP(EA), eV:	-8.82(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,3S,4R)-3-(phenylmethoxycarbonylamino)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C2=CC=C(C=C2)F)OC3C[C@H]4CC[C@H](C3)N4C

DOS

IR

Vibrations