Geometry & MOs

Info

ID:	243424
PubChem CID:	99222778
Reduced:	N3O5C19H29 (1)
Stoich.:	A3B5C19D29 (1)
Weight, g/mol:	388.191069
ΔH_f, kcal/mol:	-238.86
Dipole, Da:	3.46
IP(EA), eV:	-9.5(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)OCCOC)C)C(=O)N[C@H](C)C(=O)NC2CCCC2

DOS

IR

Vibrations