Geometry & MOs

Info

ID:	202315
PubChem CID:	79656108
Reduced:	N2O2C13H26 (1)
Stoich.:	A2B2C13D26 (1)
Weight, g/mol:	281.119798
ΔH_f, kcal/mol:	-108.78
Dipole, Da:	2.95
IP(EA), eV:	-8.71(2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(propylamino)-3-pyrazin-2-ylsulfanylcyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C2CCC(C2)(CO)NC

DOS

IR

Vibrations