Geometry & MOs

Info

ID:	439318
PubChem CID:	135229088
Reduced:	O5N8H20C26 (1)
Stoich.:	A5B8C20D26 (1)
Weight, g/mol:	399.2926
ΔH_f, kcal/mol:	-22.39
Dipole, Da:	13.06
IP(EA), eV:	-8.94(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N,N-bis(4-pentylphenyl)aniline

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2C(=CC(=O)N2)NC(=O)NC3=C4C=CC=NC4=C(C=C3)OC5=C6C(=NC=C5)NC(=O)N6

DOS

IR

Vibrations