Geometry & MOs

Info

ID:	258450
PubChem CID:	103154122
Reduced:	SN3O4C12H19 (1)
Stoich.:	AB3C4D12E19 (1)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-145.93
Dipole, Da:	4.44
IP(EA), eV:	-9.55(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-amino-3-methoxybutanoyl)amino]benzamide

Drug info:

PubChemData

Smile

COC(CC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N)CN

DOS

IR

Vibrations