Geometry & MOs

Info

ID:	347923
PubChem CID:	127272985
Reduced:	N3O3C16H29 (1)
Stoich.:	A3B3C16D29 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-152.43
Dipole, Da:	4.72
IP(EA), eV:	-9.16(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]amino]-1-morpholin-4-ylethanone

Drug info:

PubChemData

Smile

CN(CC(=O)NC1CCCCCC1)CC(=O)N2CCOCC2

DOS

IR

Vibrations