Geometry & MOs

Info

ID:	124545
PubChem CID:	50887164
Reduced:	N3O7C17H19 (1)
Stoich.:	A3B7C17D19 (1)
Weight, g/mol:	361.167794
ΔH_f, kcal/mol:	-172.72
Dipole, Da:	7.81
IP(EA), eV:	-9.21(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-methoxy-4-(2-phenylethoxy)phenyl]methylideneamino]-5-methylphenol

Drug info:

PubChemData

Smile

CCOC1=CC(=CC(=C1OCC)[N+](=O)[O-])C=C2C(=O)N(C(=O)N(C2=O)C)C

DOS

IR

Vibrations