Geometry & MOs

Info

ID:	302839
PubChem CID:	124397363
Reduced:	NOC7H11 (1)
Stoich.:	ABC7D11 (1)
Weight, g/mol:	391.157229
ΔH_f, kcal/mol:	-41.89
Dipole, Da:	4.6
IP(EA), eV:	-9.77(1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(11bS)-13,13-diphenyl-6,11b-dihydro-[1,3]benzoxazino[3,4-a][3,1]benzoxazine

Drug info:

PubChemData

Smile

C1C[C@H]2CNC(=O)[C@@H]2C1

DOS

IR

Vibrations