Geometry & MOs

Info

ID:	76333
PubChem CID:	48424791
Reduced:	NO2C7H12 (2)
Stoich.:	AB2C7D12 (2)
Weight, g/mol:	368.173607
ΔH_f, kcal/mol:	-173.13
Dipole, Da:	4.53
IP(EA), eV:	-9.82(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCN(CC1)C(=O)OC)OCC2CC2

DOS

IR

Vibrations