Geometry & MOs

Info

ID:	362006
PubChem CID:	127305352
Reduced:	ClN3O3C18H18 (1)
Stoich.:	AB3C3D18E18 (1)
Weight, g/mol:	364.156912
ΔH_f, kcal/mol:	-43.14
Dipole, Da:	1.62
IP(EA), eV:	-9.46(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclobutyl-[4-[2-(pyrazol-1-ylmethyl)morpholine-4-carbonyl]-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

CC1=C(OC2=C1C=C(C=C2)Cl)C(=O)N3CCOC(C3)CN4C=CC=N4

DOS

IR

Vibrations