Geometry & MOs

Info

ID:	190197
PubChem CID:	77966773
Reduced:	SN4O4C27H30 (1)
Stoich.:	AB4C4D27E30 (1)
Weight, g/mol:	379.9558
ΔH_f, kcal/mol:	-97.86
Dipole, Da:	4.06
IP(EA), eV:	-8.42(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3,5-dibromophenyl)methylamino]-2-hydroxypropyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(C)CNC2=C3C=NN(C3=CC(=C2)C)C4=CC=C(C=C4)C(=O)O)C

DOS

IR

Vibrations