Geometry & MOs

Info

ID:	394970
PubChem CID:	135024327
Reduced:	N3O3C36H37 (1)
Stoich.:	A3B3C36D37 (1)
Weight, g/mol:	197.9535
ΔH_f, kcal/mol:	-62.41
Dipole, Da:	8.3
IP(EA), eV:	-9.16(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

aniline;palladium

Drug info:

PubChemData

Smile

CC(C)CC1=NC=CC(=C1)C2=C(C=C(C=C2)C3=CC=CC(=C3)CCCCN4C(=O)C5=CC=CC=C5C4=O)CCC(=O)N

DOS

IR

Vibrations