Geometry & MOs

Info

ID:	155075
PubChem CID:	56320649
Reduced:	O2N5C24H33 (1)
Stoich.:	A2B5C24D33 (1)
Weight, g/mol:	425.24269
ΔH_f, kcal/mol:	-69.55
Dipole, Da:	1.84
IP(EA), eV:	-8.81(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[4-[[1-(2-pyridin-4-ylethyl)piperidin-4-yl]carbamoylamino]phenoxy]acetamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)CC1=CC=C(C=C1)NC(=O)NC2CCN(CC2)CCC3=CC=NC=C3

DOS

IR

Vibrations