Geometry & MOs

Info

ID:	322038
PubChem CID:	126668382
Reduced:	O3N6C24H34 (1)
Stoich.:	A3B6C24D34 (1)
Weight, g/mol:	477.133397
ΔH_f, kcal/mol:	-66.41
Dipole, Da:	3.97
IP(EA), eV:	-8.61(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-4-[2-propyl-4-(trifluoromethyl)phenyl]-N-pyridazin-3-yl-3,4-dihydro-2H-chromene-7-sulfonamide

Drug info:

PubChemData

Smile

CCCCOC1=NC(=C2C(=N1)N(CC(=O)N2)CC3=CC(=CC=C3)CN(CC4CC4)C(C)O)N

DOS

IR

Vibrations