Geometry & MOs

Info

ID:	367768
PubChem CID:	127325780
Reduced:	OSN2C9H10 (2)
Stoich.:	ABC2D9E10 (2)
Weight, g/mol:	362.085577
ΔH_f, kcal/mol:	-24.48
Dipole, Da:	3.73
IP(EA), eV:	-8.87(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[1-(4-methyl-1,3-thiazol-2-yl)cyclobutyl]-3,4-dihydro-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2(CCC2)NC(=O)CN3C=NC4=C(C3=O)C(=C(S4)C)C

DOS

IR

Vibrations