Geometry & MOs

Info

ID:	386140
PubChem CID:	134980884
Reduced:	CrNO5C31H37 (1)
Stoich.:	ABC5D31E37 (1)
Weight, g/mol:	278.01778
ΔH_f, kcal/mol:	-50.61
Dipole, Da:	5.44
IP(EA), eV:	-8.21(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)[C@@H](C2=CC=CC=C2[C@@H](C)N(C)C)OC(=O)[C@@H]3C[C@@H]4CC[C@H]3C4)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]

DOS

IR

Vibrations