Geometry & MOs

Info

ID:	206577
PubChem CID:	80268801
Reduced:	OSN3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	-27.97
Dipole, Da:	3.87
IP(EA), eV:	-8.72(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclopropyl-2-hydroxyethyl)-1-methylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CCC1(CCCC1)C(=O)NC2=NC3=C(S2)CNCC3

DOS

IR

Vibrations