Geometry & MOs

Info

ID:	125635
PubChem CID:	50930601
Reduced:	NiN4O4C22H34 (1)
Stoich.:	AB4C4D22E34 (1)
Weight, g/mol:	492.11877
ΔH_f, kcal/mol:	-77.66
Dipole, Da:	0.95
IP(EA), eV:	-7.65(-3.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-hydroxypent-3-en-2-one;osmium

Drug info:

PubChemData

Smile

CCN1C(C(=O)/C(=C(/NCCN/C(=C/2\C(=O)N(C(C2=O)(C)C)CC)/C)\C)/C1=O)(C)C.[Ni]

DOS

IR

Vibrations