Geometry & MOs

Info

ID:	379195
PubChem CID:	134356708
Reduced:	O4N6C19H32 (1)
Stoich.:	A4B6C19D32 (1)
Weight, g/mol:	401.151762
ΔH_f, kcal/mol:	-140.97
Dipole, Da:	11.34
IP(EA), eV:	-10.02(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(5S)-7-chloro-5-[(6-fluoropyridine-2-carbonyl)amino]-6-oxoheptyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)CN1C=NN=N1)NC(=O)C2CCCC2

DOS

IR

Vibrations