Geometry & MOs

Info

ID:	365172
PubChem CID:	127316976
Reduced:	O2N6C19H30 (1)
Stoich.:	A2B6C19D30 (1)
Weight, g/mol:	391.294725
ΔH_f, kcal/mol:	-21.39
Dipole, Da:	6.72
IP(EA), eV:	-8.65(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-tert-butyl-5-methylpyrazol-3-yl)-2-[2-[(2,6-dimethylmorpholin-4-yl)methyl]pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)CNC2(CCCCC2)C3=NOC(=N3)C)C(C)(C)C

DOS

IR

Vibrations