Geometry & MOs

Info

ID:	151379
PubChem CID:	53801166
Reduced:	SN3O6C18H25 (1)
Stoich.:	AB3C6D18E25 (1)
Weight, g/mol:	672.275941
ΔH_f, kcal/mol:	-257.7
Dipole, Da:	3.3
IP(EA), eV:	-9.12(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[(2S)-1-[[5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-[4-(pyridin-2-ylmethoxy)phenyl]pentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

DOS

IR

Vibrations