Geometry & MOs

Info

ID:	23993
PubChem CID:	607356
Reduced:	NSO4C14H15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	293.072179
ΔH_f, kcal/mol:	-128.69
Dipole, Da:	3.89
IP(EA), eV:	-8.83(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C2C(=CNC=C2C(=O)OC)C(=O)OC

DOS

IR

Vibrations