Geometry & MOs

Info

ID:	423163
PubChem CID:	135119037
Reduced:	O2N5C18H27 (1)
Stoich.:	A2B5C18D27 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-75.83
Dipole, Da:	3.9
IP(EA), eV:	-9.01(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-6-[[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]amino]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=CN=C(C=C1)NC2CCN(CC2)C(=O)N3CCCC3

DOS

IR

Vibrations