Geometry & MOs

Info

ID:	236469
PubChem CID:	92713314
Reduced:	NO3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	399.240959
ΔH_f, kcal/mol:	-89.49
Dipole, Da:	2.59
IP(EA), eV:	-8.4(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[3-(1-adamantyloxy)propyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)[C@H]2CC3=C(C=CC(=C3)OC)OC2

DOS

IR

Vibrations