Geometry & MOs

Info

ID:	196781
PubChem CID:	78877323
Reduced:	FSN3O3C20H24 (1)
Stoich.:	ABC3D3E20F24 (1)
Weight, g/mol:	368.150285
ΔH_f, kcal/mol:	-119.01
Dipole, Da:	1.33
IP(EA), eV:	-9.13(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-[(2-chlorobenzoyl)amino]-3-methylbutanoyl]-propan-2-ylamino]acetate

Drug info:

PubChemData

Smile

CC(C1=CC=CS1)NC(=O)CN2CCN(CC2)C(=O)COC3=CC=C(C=C3)F

DOS

IR

Vibrations