Geometry & MOs

Info

ID:	320837
PubChem CID:	126663839
Reduced:	NOC18H25 (1)
Stoich.:	ABC18D25 (1)
Weight, g/mol:	491.112662
ΔH_f, kcal/mol:	-28.71
Dipole, Da:	4.63
IP(EA), eV:	-9.27(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC/C=C(\C=C)/C1=CC=C(C=C1)CNC(=O)C(C)CC

DOS

IR

Vibrations