Geometry & MOs

Info

ID:	179430
PubChem CID:	76482192
Reduced:	SN2O3C6H12 (1)
Stoich.:	AB2C3D6E12 (1)
Weight, g/mol:	646.330693
ΔH_f, kcal/mol:	-142.01
Dipole, Da:	4.55
IP(EA), eV:	-9.43(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[4-[2-acetamido-3-[[1-[[1-(dipentylamino)-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-oxopropyl]phenyl]-difluoromethyl]phosphonic acid

Drug info:

PubChemData

Smile

C(CS)NC(=O)C(CC(=O)O)N

DOS

IR

Vibrations