Geometry & MOs

Info

ID:	211482
PubChem CID:	81044049
Reduced:	NOC7H14 (2)
Stoich.:	ABC7D14 (2)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-139.96
Dipole, Da:	3.98
IP(EA), eV:	-8.94(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[4-[methyl(2-propan-2-yloxyethyl)carbamoyl]pyridin-3-yl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC(CCCO)NC(=O)CC(C)C1CCCNC1

DOS

IR

Vibrations