Geometry & MOs

Info

ID:	320762
PubChem CID:	126663257
Reduced:	ON2P3C11H21 (1)
Stoich.:	AB2C3D11E21 (1)
Weight, g/mol:	333.132906
ΔH_f, kcal/mol:	-38.35
Dipole, Da:	3.0
IP(EA), eV:	-8.39(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-difluorophenyl)-2-methylidenetricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-6-amine

Drug info:

PubChemData

Smile

CCC1=C(C(=CN1P)CCN(P)P)/C=C(\C)/O

DOS

IR

Vibrations