Geometry & MOs

Info

ID:	363102
PubChem CID:	127310133
Reduced:	O3N5C19H23 (1)
Stoich.:	A3B5C19D23 (1)
Weight, g/mol:	348.216141
ΔH_f, kcal/mol:	-7.95
Dipole, Da:	3.78
IP(EA), eV:	-9.14(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-[2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)C3=CC4=C(N=C3)ON=C4C(C)C

DOS

IR

Vibrations