Geometry & MOs

Info

ID:	362075
PubChem CID:	127305687
Reduced:	SN2O2C22H26 (1)
Stoich.:	AB2C2D22E26 (1)
Weight, g/mol:	372.161997
ΔH_f, kcal/mol:	-60.93
Dipole, Da:	2.75
IP(EA), eV:	-9.06(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(3-methylphenyl)carbamoylamino]-N-(2-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-7-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC2=C(S1)C(CCC2)N(C)C(=O)CCC(=O)C3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations