Geometry & MOs

Info

ID:	284571
PubChem CID:	104053155
Reduced:	NSO2C17H27 (1)
Stoich.:	ABC2D17E27 (1)
Weight, g/mol:	334.06808
ΔH_f, kcal/mol:	-90.13
Dipole, Da:	2.84
IP(EA), eV:	-8.48(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromopyridin-3-yl)-1-(4-methoxy-2,5-dimethylphenyl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CCCNC(C1CSCCO1)C2=C(C=C(C(=C2)C)OC)C

DOS

IR

Vibrations