Geometry & MOs

Info

ID:	58442
PubChem CID:	24701460
Reduced:	OSN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	206.141913
ΔH_f, kcal/mol:	34.24
Dipole, Da:	4.22
IP(EA), eV:	-8.71(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-phenyl-N-propylpropanamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OCC2=CC=NC=C2)C(=S)N

DOS

IR

Vibrations