Geometry & MOs

Info

ID:	155678
PubChem CID:	56366860
Reduced:	BrClSF2N2O3H12C17 (1)
Stoich.:	ABCD2E2F3G12H17 (1)
Weight, g/mol:	436.122356
ΔH_f, kcal/mol:	-173.0
Dipole, Da:	1.5
IP(EA), eV:	-9.19(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-methyl-N-(4-methylphenyl)benzamide

Drug info:

PubChemData

Smile

C1C(=O)N(C2=C(O1)C=C(C=C2)Br)CC(=O)NC3=C(C(=CC=C3)Cl)SC(F)F

DOS

IR

Vibrations