Geometry & MOs

Info

ID:	394705
PubChem CID:	135023579
Reduced:	NOH15C19 (1)
Stoich.:	ABC15D19 (1)
Weight, g/mol:	275.131014
ΔH_f, kcal/mol:	33.22
Dipole, Da:	1.81
IP(EA), eV:	-8.53(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-phenyl-3,4-dihydro-1H-benzo[h]isochromen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC2C3=CC=CC=C3C4=CC=CC=C4O2

DOS

IR

Vibrations