Geometry & MOs

Info

ID:	179406
PubChem CID:	76478175
Reduced:	FON2C10H11 (1)
Stoich.:	ABC2D10E11 (1)
Weight, g/mol:	616.326085
ΔH_f, kcal/mol:	-40.68
Dipole, Da:	9.33
IP(EA), eV:	-8.53(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[1-[2-[1-(hexanoylamino)-4-hydroxy-3-methyl-1-oxo-2-[(2-phenylphenyl)methyl]butan-2-yl]hydrazinyl]-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1CNCNC1=C2C=CC(=O)C(=C2)F

DOS

IR

Vibrations