Geometry & MOs

Info

ID:	424156
PubChem CID:	135121553
Reduced:	N4O4H18C19 (1)
Stoich.:	A4B4C18D19 (1)
Weight, g/mol:	376.334131
ΔH_f, kcal/mol:	-70.35
Dipole, Da:	8.09
IP(EA), eV:	-9.03(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-heptadecyl-5-methoxy-2-methylphenol

Drug info:

PubChemData

Smile

CC(=O)N1CC(=O)N(C2=CC=CC=C21)CC(=O)NNC=C3C=CC(=O)C=C3

DOS

IR

Vibrations