Geometry & MOs

Info

ID:	358712
PubChem CID:	127296526
Reduced:	N3O3C20H25 (1)
Stoich.:	A3B3C20D25 (1)
Weight, g/mol:	337.182398
ΔH_f, kcal/mol:	-65.43
Dipole, Da:	7.3
IP(EA), eV:	-9.0(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(4-propoxyazepan-1-yl)acetamide

Drug info:

PubChemData

Smile

CCCOC1CCCN(CC1)CC2=NC(=O)C3=C(N2)C4=CC=CC=C4O3

DOS

IR

Vibrations