Geometry & MOs

Info

ID:	343580
PubChem CID:	127266753
Reduced:	N2O3C12H16 (1)
Stoich.:	A2B3C12D16 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-87.01
Dipole, Da:	2.8
IP(EA), eV:	-9.06(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[2-(methylcarbamoyl)cyclopentyl]amino]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC1(CN(C1)C2=C(C=NC=C2)C(=O)OC)OC

DOS

IR

Vibrations