Geometry & MOs

Info

ID:	275798
PubChem CID:	103817837
Reduced:	SN3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	367.99272
ΔH_f, kcal/mol:	51.71
Dipole, Da:	5.77
IP(EA), eV:	-8.29(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(5-bromo-2-hydroxyphenyl)methylamino]-2-chlorophenyl]acetamide

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)CNC2=CC=C(C=C2)SC

DOS

IR

Vibrations