Geometry & MOs

Info

ID:	287864
PubChem CID:	104296732
Reduced:	BrNC18H22 (1)
Stoich.:	ABC18D22 (1)
Weight, g/mol:	333.07283
ΔH_f, kcal/mol:	22.69
Dipole, Da:	2.78
IP(EA), eV:	-9.02(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromo-3-methylphenyl)-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(C2=CC=C(C=C2)C(C)C)NC)Br

DOS

IR

Vibrations