Geometry & MOs

Info

ID:	64007
PubChem CID:	26759678
Reduced:	SCl2N3O5C20H21 (1)
Stoich.:	AB2C3D5E20F21 (1)
Weight, g/mol:	483.146407
ΔH_f, kcal/mol:	-177.18
Dipole, Da:	5.93
IP(EA), eV:	-9.3(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-5-[(4-methyl-3-morpholin-4-ylsulfonylphenyl)carbamoyl]phenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CNC(=O)C2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations