Geometry & MOs

Info

ID:	186932
PubChem CID:	77506905
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	466.297762
ΔH_f, kcal/mol:	-85.56
Dipole, Da:	8.66
IP(EA), eV:	-9.49(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-butyl-2-tert-butyl-1,2-thiazol-5-ylidene)-3-(2-hydroxypropylcarbamoylamino)-1,2,2-trimethylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CN=C(C(=C1OC)C)CNC(CC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations