Geometry & MOs

Info

ID:	392371
PubChem CID:	135014803
Reduced:	ClNOH14C16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	287.131014
ΔH_f, kcal/mol:	-0.92
Dipole, Da:	2.0
IP(EA), eV:	-9.41(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,8bR)-2-naphthalen-1-yl-2,3a,4,8b-tetrahydro-1H-indeno[1,2-d][1,3]oxazole

Drug info:

PubChemData

Smile

C1[C@H]2[C@@H](C3=CC=CC=C31)NC(O2)C4=CC=CC=C4Cl

DOS

IR

Vibrations