Geometry & MOs

Info

ID:	70677
PubChem CID:	48413706
Reduced:	N3O3C22H29 (1)
Stoich.:	A3B3C22D29 (1)
Weight, g/mol:	407.19574
ΔH_f, kcal/mol:	-75.86
Dipole, Da:	6.65
IP(EA), eV:	-8.48(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-6-pyrazol-1-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C(=O)NC(CN2CCOCC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations