Geometry & MOs

Info

ID:	61093
PubChem CID:	26705593
Reduced:	FN2O2C17H17 (1)
Stoich.:	AB2C2D17E17 (1)
Weight, g/mol:	369.114713
ΔH_f, kcal/mol:	-89.6
Dipole, Da:	4.75
IP(EA), eV:	-9.12(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[3-[(6-ethyl-1,3-benzothiazol-2-yl)carbamoyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)N(C)C)F

DOS

IR

Vibrations