Geometry & MOs

Info

ID:	150840
PubChem CID:	53790536
Reduced:	FN4C28H37 (1)
Stoich.:	AB4C28D37 (1)
Weight, g/mol:	475.195465
ΔH_f, kcal/mol:	-14.34
Dipole, Da:	2.56
IP(EA), eV:	-8.46(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 4-[2-(4-acetamidobutoxy)-5-nitrophenyl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CC1CCCCN1C(=NC2CCCCC2)N=C(C3=C(C=CC=C3C)C)NC4=CC=C(C=C4)F

DOS

IR

Vibrations