Geometry & MOs

Info

ID:	367787
PubChem CID:	127325823
Reduced:	O2S2N3C17H25 (1)
Stoich.:	A2B2C3D17E25 (1)
Weight, g/mol:	291.115381
ΔH_f, kcal/mol:	-73.9
Dipole, Da:	1.38
IP(EA), eV:	-8.69(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]-3-(1,2,4-triazol-1-yl)propanamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCC2)NC(=O)CSCC(=O)N3CCCCC3

DOS

IR

Vibrations