Geometry & MOs

Info

ID:	174162
PubChem CID:	75732972
Reduced:	NOC9H15 (3)
Stoich.:	ABC9D15 (3)
Weight, g/mol:	442.262028
ΔH_f, kcal/mol:	-181.28
Dipole, Da:	3.36
IP(EA), eV:	-9.36(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexylamino)-2-oxo-1-phenanthren-9-ylethyl]-2-methyl-N-propylprop-2-enamide

Drug info:

PubChemData

Smile

CCCN(C(C(CC)CC)C(=O)NC(C)(C)CC(C)(C)C)C(=O)CNC(=O)C1=CC=CC=C1

DOS

IR

Vibrations