Geometry & MOs

Info

ID:	418604
PubChem CID:	135106133
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	277.19026
ΔH_f, kcal/mol:	-124.65
Dipole, Da:	1.55
IP(EA), eV:	-8.91(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[4-(dimethylamino)-5-methylpyrimidin-2-yl]pyrrolidin-3-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)CC3=CC=C(C=C3)O)CO

DOS

IR

Vibrations