Geometry & MOs

Info

ID:	311236
PubChem CID:	126590000
Reduced:	NOH17C21 (1)
Stoich.:	ABC17D21 (1)
Weight, g/mol:	369.092042
ΔH_f, kcal/mol:	109.67
Dipole, Da:	1.07
IP(EA), eV:	-8.36(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chlorophenyl)-14-oxatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-12-amine

Drug info:

PubChemData

Smile

CC1=CC2C3=C(C=CC4=C3OC5=C(C=CC=C45)C)C=CN2C=C1

DOS

IR

Vibrations