Geometry & MOs

Info

ID:	236467
PubChem CID:	92713311
Reduced:	NO3C18H19 (1)
Stoich.:	AB3C18D19 (1)
Weight, g/mol:	375.04701
ΔH_f, kcal/mol:	-90.16
Dipole, Da:	3.96
IP(EA), eV:	-8.48(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(2-bromophenyl)methyl]-6-methoxy-3,4-dihydro-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations