Geometry & MOs

Info

ID:	151061
PubChem CID:	53790758
Reduced:	BrPSO2N3C7H9 (1)
Stoich.:	ABCD2E3F7G9 (1)
Weight, g/mol:	479.506616
ΔH_f, kcal/mol:	-66.88
Dipole, Da:	2.09
IP(EA), eV:	-9.48(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-triacontan-13-ylacetamide

Drug info:

PubChemData

Smile

C1=C(SC=C1Br)C=CC(=O)NP(=N)(N)O

DOS

IR

Vibrations