Geometry & MOs

Info

ID:	342933
PubChem CID:	127266096
Reduced:	O3N4C18H24 (1)
Stoich.:	A3B4C18D24 (1)
Weight, g/mol:	262.142976
ΔH_f, kcal/mol:	-114.72
Dipole, Da:	2.51
IP(EA), eV:	-8.85(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-2-[(6-methylpyridin-2-yl)carbamoylamino]cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NC(=O)N[C@@H]3CCC[C@@H]3C(=O)N

DOS

IR

Vibrations