Geometry & MOs

Info

ID:	246572
PubChem CID:	103061309
Reduced:	N3C5H7 (2)
Stoich.:	A3B5C7 (2)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	87.72
Dipole, Da:	1.76
IP(EA), eV:	-9.14(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-phenylpyrrolidin-1-yl)methyl]oxan-4-ol

Drug info:

PubChemData

Smile

CC1=CC(=NN1CC2=CN=C(C=N2)NN)C

DOS

IR

Vibrations