Geometry & MOs

Info

ID:	265679
PubChem CID:	103538380
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	263.163377
ΔH_f, kcal/mol:	-87.64
Dipole, Da:	4.73
IP(EA), eV:	-8.43(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(ethylamino)-6-methylpyridin-4-yl]-(3-methoxypyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

CCCNC1=C(C=CC(=C1)C)C(=O)N2CCC(C2)OC

DOS

IR

Vibrations