Geometry & MOs

Info

ID:	15292
PubChem CID:	436273
Reduced:	BrNOC27H34 (1)
Stoich.:	ABCD27E34 (1)
Weight, g/mol:	467.18238
ΔH_f, kcal/mol:	-20.06
Dipole, Da:	2.06
IP(EA), eV:	-8.6(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(9-bromophenanthren-3-yl)-2-(dipentylamino)propan-1-one

Drug info:

PubChemData

Smile

CCCCCN(CCCCC)C(C)C(=O)C1=CC2=C(C=C1)C=C(C3=CC=CC=C32)Br

DOS

IR

Vibrations