Geometry & MOs

Info

ID:	300089
PubChem CID:	119526744
Reduced:	ClN2O2C16H27 (1)
Stoich.:	AB2C2D16E27 (1)
Weight, g/mol:	374.176106
ΔH_f, kcal/mol:	-136.18
Dipole, Da:	7.49
IP(EA), eV:	-9.49(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-3,4-dihydro-2H-chromene-4-carboxamide;hydrochloride

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(CNC(=O)COC(C)C)N.Cl

DOS

IR

Vibrations