Geometry & MOs

Info

ID:	190750
PubChem CID:	78051832
Reduced:	SO2N4C25H30 (1)
Stoich.:	AB2C4D25E30 (1)
Weight, g/mol:	394.135114
ΔH_f, kcal/mol:	13.02
Dipole, Da:	2.82
IP(EA), eV:	-8.43(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-phenyl-3,4-dihydro-2H-chromen-6-yl)oxy]-N-propyl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1CC(NN1)C(C)NCC2=CN=C(S2)OC3=CC4=C(C=C3)OC(CC4)C5=CC=CC=C5

DOS

IR

Vibrations