Geometry & MOs

Info

ID:	198489
PubChem CID:	79108017
Reduced:	N2O2C17H28 (1)
Stoich.:	A2B2C17D28 (1)
Weight, g/mol:	352.07864
ΔH_f, kcal/mol:	-66.5
Dipole, Da:	4.61
IP(EA), eV:	-8.3(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-4-methylphenoxy)-3-[(2,5-dimethylpyrrol-1-yl)amino]propan-2-ol

Drug info:

PubChemData

Smile

CC1CC=CCC1COCC(CNN2C(=CC=C2C)C)O

DOS

IR

Vibrations