Geometry & MOs

Info

ID:	159275
PubChem CID:	57269404
Reduced:	N2O5C16H20 (1)
Stoich.:	A2B5C16D20 (1)
Weight, g/mol:	409.009548
ΔH_f, kcal/mol:	-172.3
Dipole, Da:	6.03
IP(EA), eV:	-9.14(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dichlorophenyl)-5-methoxycarbonyl-2-methyl-6-(trifluoromethyl)-3,4-dihydropyridine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(=CC(=O)[C@](CC1=CC=C(C=C1)OC)(C(=O)N)NC)C(=O)O

DOS

IR

Vibrations