Geometry & MOs

Info

ID:	206261
PubChem CID:	80224376
Reduced:	NOC17H33 (1)
Stoich.:	ABC17D33 (1)
Weight, g/mol:	315.107519
ΔH_f, kcal/mol:	-99.34
Dipole, Da:	2.92
IP(EA), eV:	-8.54(2.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[5-[cyclopentyl(2-methylpropyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetic acid

Drug info:

PubChemData

Smile

CC1CCC(C(C1)N(CCC(C)C)C2CCCC2)O

DOS

IR

Vibrations