Geometry & MOs

Info

ID:	367783
PubChem CID:	127325819
Reduced:	OSN5C20H25 (1)
Stoich.:	ABC5D20E25 (1)
Weight, g/mol:	358.182733
ΔH_f, kcal/mol:	32.57
Dipole, Da:	4.1
IP(EA), eV:	-9.18(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)N1C2=NC(=CC(=C2C=N1)C(=O)NC3(CCC3)C4=NC(=CS4)C)C

DOS

IR

Vibrations