Geometry & MOs

Info

ID:	383166
PubChem CID:	134974737
Reduced:	BO4C17H29 (1)
Stoich.:	AB4C17D29 (1)
Weight, g/mol:	328.157563
ΔH_f, kcal/mol:	-281.41
Dipole, Da:	3.27
IP(EA), eV:	-10.24(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-9-(dimethylamino)phenanthridin-6-one

Drug info:

PubChemData

Smile

B1(OC2CC3CC([C@]2(O1)C)C3(C)C)CCC(=O)OC(C)(C)C

DOS

IR

Vibrations