Geometry & MOs

Info

ID:	286761
PubChem CID:	104222308
Reduced:	ON4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	264.195011
ΔH_f, kcal/mol:	-27.59
Dipole, Da:	3.83
IP(EA), eV:	-8.6(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-[(propan-2-ylamino)methyl]pyrimidin-2-yl]pyrrolidin-3-yl]ethanol

Drug info:

PubChemData

Smile

CCNCC1=CN=C(N=C1)N2CCC(C2)C(C)O

DOS

IR

Vibrations