Geometry & MOs

Info

ID:	149696
PubChem CID:	53789370
Reduced:	ON2C13H19 (2)
Stoich.:	AB2C13D19 (2)
Weight, g/mol:	46.034439
ΔH_f, kcal/mol:	77.44
Dipole, Da:	4.32
IP(EA), eV:	-8.36(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tritioacetaldehyde

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCCNC(=O)[C@H](CCCCN)N(CCC2=CC=CC=C2)C(=O)CCN

DOS

IR

Vibrations