Geometry & MOs

Info

ID:	144082
PubChem CID:	53308534
Reduced:	BrClNO10C18H19 (1)
Stoich.:	ABCD10E18F19 (1)
Weight, g/mol:	201.115364
ΔH_f, kcal/mol:	-345.69
Dipole, Da:	10.9
IP(EA), eV:	-9.73(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethoxy-1-naphthalen-2-ylmethanamine

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC2=C(C=C(C=C2)[N+](=O)[O-])Cl)CBr

DOS

IR

Vibrations