Geometry & MOs

Info

ID:	266843
PubChem CID:	103579729
Reduced:	BrO2N3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	285.07283
ΔH_f, kcal/mol:	-70.0
Dipole, Da:	3.19
IP(EA), eV:	-8.9(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromo-3,5-dimethylanilino)pentan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)NCC2=CC(=O)N(C(=O)N2C)C

DOS

IR

Vibrations