Geometry & MOs

Info

ID:	145407
PubChem CID:	53518140
Reduced:	NOC6H9 (3)
Stoich.:	ABC6D9 (3)
Weight, g/mol:	349.146013
ΔH_f, kcal/mol:	-110.63
Dipole, Da:	1.14
IP(EA), eV:	-8.31(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-4-oxobutyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N2CCOCC2)NC(C)C(=O)N3CCOCC3

DOS

IR

Vibrations