Geometry & MOs

Info

ID:	375730
PubChem CID:	134221139
Reduced:	OC15H18 (1)
Stoich.:	AB15C18 (1)
Weight, g/mol:	197.060742
ΔH_f, kcal/mol:	-25.1
Dipole, Da:	2.03
IP(EA), eV:	-8.97(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-1,3,4,5-tetrahydro-2-benzoxepin-5-amine

Drug info:

PubChemData

Smile

CC1COCC2=C1C3=C(C=C2)C4CCC3C4

DOS

IR

Vibrations