Geometry & MOs

Info

ID:	371242
PubChem CID:	127344462
Reduced:	O2N4C17H20 (1)
Stoich.:	A2B4C17D20 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-30.86
Dipole, Da:	2.77
IP(EA), eV:	-8.89(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-chromen-4-ylmethyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1COC2=CC=CC=C2C1CNC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations