Geometry & MOs

Info

ID:	160827
PubChem CID:	57389909
Reduced:	NO4C29H45 (1)
Stoich.:	AB4C29D45 (1)
Weight, g/mol:	401.256609
ΔH_f, kcal/mol:	-151.44
Dipole, Da:	2.05
IP(EA), eV:	-8.1(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-dimethoxyphenyl)-N-[4-(3,4-dimethoxyphenyl)butyl]butan-1-amine

Drug info:

PubChemData

Smile

CC(C)N(CCCCCC1=CC(=C(C=C1)OC)OC)CCCCCC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations