Geometry & MOs

Info

ID:	201945
PubChem CID:	79607628
Reduced:	BrNOC17H26 (1)
Stoich.:	ABCD17E26 (1)
Weight, g/mol:	261.209264
ΔH_f, kcal/mol:	-40.55
Dipole, Da:	3.32
IP(EA), eV:	-8.64(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-5-(2-methoxyphenyl)-4-methylpent-3-en-1-amine

Drug info:

PubChemData

Smile

CC(=CCCNC(C)(C)C)CC1=CC(=C(C=C1)OC)Br

DOS

IR

Vibrations