Geometry & MOs

Info

ID:	423500
PubChem CID:	135119611
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	264.183778
ΔH_f, kcal/mol:	-78.41
Dipole, Da:	5.01
IP(EA), eV:	-9.18(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-3-hydroxypiperidin-1-yl)-(1-propan-2-ylpyrrol-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)CC(=O)N2C[C@H]([C@H](C2)OC)CC3=CC(=NO3)C

DOS

IR

Vibrations