Geometry & MOs

Info

ID:	65164
PubChem CID:	29204553
Reduced:	BrFSN2O4H18C21 (1)
Stoich.:	ABCD2E4F18G21 (1)
Weight, g/mol:	483.146407
ΔH_f, kcal/mol:	-135.5
Dipole, Da:	7.18
IP(EA), eV:	-8.19(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[4-[[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]carbamoyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)F)Br)S(=O)(=O)NC3=CC=C(C=C3)OC

DOS

IR

Vibrations