Geometry & MOs

Info

ID:	421018
PubChem CID:	135115242
Reduced:	SO2N4C15H24 (1)
Stoich.:	AB2C4D15E24 (1)
Weight, g/mol:	314.210661
ΔH_f, kcal/mol:	-70.48
Dipole, Da:	4.13
IP(EA), eV:	-9.27(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-(1H-imidazol-5-ylmethyl)-3-phenylbutanamide

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)NC2CCN(CC2)C3CCS(=O)(=O)CC3

DOS

IR

Vibrations