Geometry & MOs

Info

ID:	126833
PubChem CID:	50980423
Reduced:	NOC10H11 (2)
Stoich.:	ABC10D11 (2)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	-9.09
Dipole, Da:	7.38
IP(EA), eV:	-8.84(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CN(C(C1CC1)C2CC2)C(=O)C3=CN4CCC5=C4C(=CC=C5)C3=O

DOS

IR

Vibrations