Geometry & MOs

Info

ID:	20771
PubChem CID:	585617
Reduced:	OPN3C16H26 (1)
Stoich.:	ABC3D16E26 (1)
Weight, g/mol:	307.181349
ΔH_f, kcal/mol:	-69.98
Dipole, Da:	3.92
IP(EA), eV:	-8.87(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[dimethylamino-(1-prop-2-enyl-3,4-dihydro-1H-isoquinolin-2-yl)phosphoryl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CN(C)P(=O)(N1CCC2=CC=CC=C2C1CC=C)N(C)C

DOS

IR

Vibrations