Geometry & MOs

Info

ID:	263334
PubChem CID:	103358006
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	292.189926
ΔH_f, kcal/mol:	-145.68
Dipole, Da:	6.54
IP(EA), eV:	-9.16(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(3-hydroxy-3-methylpyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCN(C1)CCOC2=CC=CC(=C2)/C=C/C(=O)O)O

DOS

IR

Vibrations