Geometry & MOs

Info

ID:	43004
PubChem CID:	10317693
Reduced:	N5O7C15H19 (1)
Stoich.:	A5B7C15D19 (1)
Weight, g/mol:	381.136493
ΔH_f, kcal/mol:	-258.63
Dipole, Da:	3.41
IP(EA), eV:	-9.24(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R)-2-oxo-1-phenanthren-9-yl-4-phenylazetidin-3-yl] acetate

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=O)C2=C(N1)N=CN2COC(COC(=O)C)COC(=O)C

DOS

IR

Vibrations