Geometry & MOs

Info

ID:	275266
PubChem CID:	103814915
Reduced:	OSN3C12H27 (1)
Stoich.:	ABC3D12E27 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	-71.82
Dipole, Da:	2.72
IP(EA), eV:	-8.46(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[2-[ethyl(propyl)amino]ethyl]-2-phenylpropanamide

Drug info:

PubChemData

Smile

CCCN(CC)CCNC(=O)[C@H](CCSC)N

DOS

IR

Vibrations