Geometry & MOs

Info

ID:	282203
PubChem CID:	103918666
Reduced:	BrN2O2C14H21 (1)
Stoich.:	AB2C2D14E21 (1)
Weight, g/mol:	305.04153
ΔH_f, kcal/mol:	-85.45
Dipole, Da:	2.81
IP(EA), eV:	-8.68(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromo-2-methylanilino)methyl]-6-methylphenol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1O)CN(C)CC(C)C(=O)NC)Br

DOS

IR

Vibrations