Geometry & MOs

Info

ID:	187749
PubChem CID:	77619004
Reduced:	FSN2O5C19H23 (1)
Stoich.:	ABC2D5E19F23 (1)
Weight, g/mol:	567.290863
ΔH_f, kcal/mol:	-208.12
Dipole, Da:	4.51
IP(EA), eV:	-8.73(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-[1-(3,5-difluorophenyl)-4-[(3-ethylphenyl)methylamino]-3-hydroxybutan-2-yl]-3-N-(2-methoxyethyl)-3-N,5-dimethylbenzene-1,3-dicarboxamide

Drug info:

PubChemData

Smile

C1CC1C(=O)NCC2CN(C(=O)O2)C3=CC(=C(C=C3)C4C5C4CS(C5)(O)O)F

DOS

IR

Vibrations