Geometry & MOs

Info

ID:	390769
PubChem CID:	135000832
Reduced:	NSO5C14H15 (1)
Stoich.:	ABC5D14E15 (1)
Weight, g/mol:	162.01602
ΔH_f, kcal/mol:	-165.39
Dipole, Da:	3.75
IP(EA), eV:	-10.59(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethylpropanoyloxymethylidenetitanium

Drug info:

PubChemData

Smile

CC(C)OC(=O)CC(=O)CC1=NS(=O)(=O)C2=CC=CC=C21

DOS

IR

Vibrations