Geometry & MOs

Info

ID:	434400
PubChem CID:	135174850
Reduced:	NO2C18H27 (2)
Stoich.:	AB2C18D27 (2)
Weight, g/mol:	189.172879
ΔH_f, kcal/mol:	-167.76
Dipole, Da:	4.09
IP(EA), eV:	-8.25(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-(4-propoxybutoxy)ethanamine

Drug info:

PubChemData

Smile

CC(CNC(C)(C)C)OC1=CC2=C(C=C1)C=C(O2)C(C)(C)C(C)(C)NC3CC(C3)OC4=CC=CC(=C4)OCC(C)(C)C

DOS

IR

Vibrations