Geometry & MOs

Info

ID:	190424
PubChem CID:	78003011
Reduced:	P2C5O9H12 (2)
Stoich.:	A2B5C9D12 (2)
Weight, g/mol:	241.127821
ΔH_f, kcal/mol:	-1063.68
Dipole, Da:	7.27
IP(EA), eV:	-10.23(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-amino-7-methyl-3,4-dihydro-2H-naphthalen-1-yl)-2,2-difluoroethanol

Drug info:

PubChemData

Smile

CCOC1C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OCC)OP(=O)(O)O)OP(=O)(O)O

DOS

IR

Vibrations