Geometry & MOs

Info

ID:	367742
PubChem CID:	127325714
Reduced:	SN2O3C17H26 (1)
Stoich.:	AB2C3D17E26 (1)
Weight, g/mol:	332.167083
ΔH_f, kcal/mol:	-118.49
Dipole, Da:	3.48
IP(EA), eV:	-9.41(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-5-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCC2)NC(=O)C(C)OCC3CCCCO3

DOS

IR

Vibrations