Geometry & MOs

Info

ID:	131537
PubChem CID:	51222605
Reduced:	SO2N3C19H27 (1)
Stoich.:	AB2C3D19E27 (1)
Weight, g/mol:	373.272927
ΔH_f, kcal/mol:	-90.0
Dipole, Da:	3.62
IP(EA), eV:	-8.67(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]-2-[(2-phenylacetyl)amino]butanamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C

DOS

IR

Vibrations