Geometry & MOs

Info

ID:	184481
PubChem CID:	77166755
Reduced:	O3C21H28 (1)
Stoich.:	A3B21C28 (1)
Weight, g/mol:	738.261872
ΔH_f, kcal/mol:	-144.18
Dipole, Da:	6.38
IP(EA), eV:	-9.88(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-[5-chloro-4-(2-cyanopropan-2-yl)-2-ethoxyphenyl]-4,5-bis(4-chlorophenyl)imidazolidine-2-carbonyl]piperazin-1-yl]-N-methyl-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CC1CC2C3CCC4=CC(=O)C=CC4(C3CCC2(C1C(=O)O)C)C

DOS

IR

Vibrations