Geometry & MOs

Info

ID:	155675
PubChem CID:	56366846
Reduced:	BrSN3O3C17H18 (1)
Stoich.:	ABC3D3E17F18 (1)
Weight, g/mol:	376.04226
ΔH_f, kcal/mol:	-91.46
Dipole, Da:	7.57
IP(EA), eV:	-8.83(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-bromophenyl)-4-(methoxymethyl)benzamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=C(C=C1)Br)NC(=O)CCCNC(=O)C2=CC=CS2

DOS

IR

Vibrations