Geometry & MOs

Info

ID:	397965
PubChem CID:	135031165
Reduced:	NO2C18H19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	335.107692
ΔH_f, kcal/mol:	-25.67
Dipole, Da:	4.07
IP(EA), eV:	-8.16(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

17-(2-chlorophenyl)-11-oxa-16-azatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,8-pentaene

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)OC3CCCN3C2C4=CC=CC=C4

DOS

IR

Vibrations