Geometry & MOs

Info

ID:	123585
PubChem CID:	50854930
Reduced:	N3O3C23H25 (1)
Stoich.:	A3B3C23D25 (1)
Weight, g/mol:	374.199428
ΔH_f, kcal/mol:	-88.32
Dipole, Da:	9.29
IP(EA), eV:	-9.28(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclohexylpyrrol-3-yl)-N-[4-(4-methoxyphenoxy)phenyl]methanimine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1N2C(=O)/C(=C\C3=CN(C=C3)C4CCCCC4)/C(=O)NC2=O

DOS

IR

Vibrations