Geometry & MOs

Info

ID:	245903
PubChem CID:	103026975
Reduced:	OSN3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	343.11469
ΔH_f, kcal/mol:	1.39
Dipole, Da:	0.74
IP(EA), eV:	-8.8(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-5-methoxyphenyl)-N-ethyl-4-methoxy-4-methylpentan-2-amine

Drug info:

PubChemData

Smile

CC(C)(CCC(C1=CC2=C(C=CS2)N=C1)NN)OC

DOS

IR

Vibrations