Geometry & MOs

Info

ID:	377020
PubChem CID:	134223055
Reduced:	N2O3C16H24 (1)
Stoich.:	A2B3C16D24 (1)
Weight, g/mol:	264.147393
ΔH_f, kcal/mol:	-116.05
Dipole, Da:	5.1
IP(EA), eV:	-8.42(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3R,4S)-4-amino-3-methyl-3,4-dihydro-1H-isochromen-7-yl] N-ethyl-N-methylcarbamate

Drug info:

PubChemData

Smile

CCN(C)C(=O)OC1=CC2=C(CO[C@H]([C@H]2N(C)C)C)C=C1

DOS

IR

Vibrations