Geometry & MOs

Info

ID:	382739
PubChem CID:	134974064
Reduced:	NOC29H37 (1)
Stoich.:	ABC29D37 (1)
Weight, g/mol:	470.318481
ΔH_f, kcal/mol:	-14.34
Dipole, Da:	3.25
IP(EA), eV:	-8.74(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC[C@H]1[C@@H]2CCCC2=C(C1=O)[C@H](CC(C)C)N(CC3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations