Geometry & MOs

Info

ID:	415891
PubChem CID:	135088893
Reduced:	SN2O2C16H20 (1)
Stoich.:	AB2C2D16E20 (1)
Weight, g/mol:	372.216141
ΔH_f, kcal/mol:	-46.46
Dipole, Da:	3.66
IP(EA), eV:	-8.71(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-6-methoxy-N-[(5-methyl-1H-imidazol-4-yl)methyl]-3,4-dihydro-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCC(=O)O)CC2=CC3=CC=CC=C3S2

DOS

IR

Vibrations