Geometry & MOs

Info

ID:	139056
PubChem CID:	52465941
Reduced:	N2O3C21H32 (1)
Stoich.:	A2B3C21D32 (1)
Weight, g/mol:	224.061949
ΔH_f, kcal/mol:	-147.67
Dipole, Da:	4.43
IP(EA), eV:	-8.93(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfanyl-5-nitropyridine

Drug info:

PubChemData

Smile

CC[C@@H](C1=CC=C(C=C1)OC)NC(=O)C2CCN(CC2)C(=O)C(C)(C)C

DOS

IR

Vibrations