Geometry & MOs

Info

ID:	260167
PubChem CID:	103183701
Reduced:	BrNO2C16H26 (1)
Stoich.:	ABC2D16E26 (1)
Weight, g/mol:	259.251129
ΔH_f, kcal/mol:	-79.36
Dipole, Da:	2.63
IP(EA), eV:	-9.0(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-methoxypropoxy)ethyl]-3,3-dimethyl-N-propylbutan-1-amine

Drug info:

PubChemData

Smile

CCNCC(CCOCCCOC)C1=CC(=CC=C1)Br

DOS

IR

Vibrations