Geometry & MOs

Info

ID:	364072
PubChem CID:	127313861
Reduced:	NOC14H27 (1)
Stoich.:	ABC14D27 (1)
Weight, g/mol:	322.146347
ΔH_f, kcal/mol:	-79.16
Dipole, Da:	2.98
IP(EA), eV:	-8.52(2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[methyl-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]amino]acetamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)N(C)CC2CCOCC2

DOS

IR

Vibrations