Geometry & MOs

Info

ID:	196450
PubChem CID:	78828634
Reduced:	SO3N5C19H27 (1)
Stoich.:	AB3C5D19E27 (1)
Weight, g/mol:	422.268176
ΔH_f, kcal/mol:	-66.85
Dipole, Da:	6.43
IP(EA), eV:	-9.13(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-phenylphenyl)propanamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C

DOS

IR

Vibrations