Geometry & MOs

Info

ID:	412262
PubChem CID:	135085146
Reduced:	NiPCl2N2C45H53 (1)
Stoich.:	ABC2D2E45F53 (1)
Weight, g/mol:	644.30894
ΔH_f, kcal/mol:	17796.95
Dipole, Da:	8.96
IP(EA), eV:	-5.76(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-2-phenylpropan-2-amine;gadolinium(3+)

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)N2CCN([C]2)C3=C(C=CC=C3C(C)C)C(C)C.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ni]Cl

DOS

IR

Vibrations