Geometry & MOs

Info

ID:	270546
PubChem CID:	103637081
Reduced:	BrNO2C16H16 (1)
Stoich.:	ABC2D16E16 (1)
Weight, g/mol:	314.06299
ΔH_f, kcal/mol:	-35.38
Dipole, Da:	4.92
IP(EA), eV:	-8.85(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-bromo-2-hydroxyphenyl)methylamino]-N-tert-butylacetamide

Drug info:

PubChemData

Smile

C1C(OC2=CC=CC=C21)CNCC3=C(C=CC(=C3)Br)O

DOS

IR

Vibrations