Geometry & MOs

Info

ID:	283993
PubChem CID:	104024643
Reduced:	N2O2H14C15 (1)
Stoich.:	A2B2C14D15 (1)
Weight, g/mol:	307.053069
ΔH_f, kcal/mol:	-7.51
Dipole, Da:	5.73
IP(EA), eV:	-8.84(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-chloro-2-(chloromethyl)phenyl]-3,4-dihydro-2H-1,5-benzoxazepine

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C2OC1)C3=NC=C(C=C3)C=O

DOS

IR

Vibrations