Geometry & MOs

Info

ID:	330630
PubChem CID:	127248037
Reduced:	O2N4C17H28 (1)
Stoich.:	A2B4C17D28 (1)
Weight, g/mol:	341.185175
ΔH_f, kcal/mol:	-77.79
Dipole, Da:	4.37
IP(EA), eV:	-9.03(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-hydroxy-3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]-(6-imidazol-1-ylpyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)CCC(=O)N2CCC(C2)(CN3CCCC3)O

DOS

IR

Vibrations