Geometry & MOs

Info

ID:	181873
PubChem CID:	76807866
Reduced:	N2O5C30H32 (1)
Stoich.:	A2B5C30D32 (1)
Weight, g/mol:	436.139901
ΔH_f, kcal/mol:	-158.92
Dipole, Da:	16.57
IP(EA), eV:	-8.43(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-[(6-oxo-3-piperidin-4-ylidenecyclohexa-1,4-diene-1-carbonyl)amino]-4-phenylbenzoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)C1=C(C=C(C=C1)C2=CC=CC=C2OC)NC(=O)C3=CC(=C4CCCCN4)C=CC3=O

DOS

IR

Vibrations