Geometry & MOs

Info

ID:	270567
PubChem CID:	103637131
Reduced:	BrON2C14H15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	314.06299
ΔH_f, kcal/mol:	5.91
Dipole, Da:	3.07
IP(EA), eV:	-9.02(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-2-hydroxyphenyl)methylamino]-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)CCNCC2=C(C=CC(=C2)Br)O

DOS

IR

Vibrations