Geometry & MOs

Info

ID:	167357
PubChem CID:	74814700
Reduced:	O2N3C26H39 (1)
Stoich.:	A2B3C26D39 (1)
Weight, g/mol:	439.199488
ΔH_f, kcal/mol:	60.72
Dipole, Da:	48.89
IP(EA), eV:	-2.97(-2.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(prop-2-enyl) 4-(3-methoxy-4-prop-2-enoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C[NH+]2CCC(CC2)CCC(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

DOS

IR

Vibrations