Geometry & MOs

Info

ID:	198352
PubChem CID:	79090798
Reduced:	N2H18C19 (1)
Stoich.:	A2B18C19 (1)
Weight, g/mol:	298.087291
ΔH_f, kcal/mol:	83.51
Dipole, Da:	2.79
IP(EA), eV:	-8.3(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-chlorophenyl)-(pyrrol-1-ylamino)methyl]phenol

Drug info:

PubChemData

Smile

CC1=CC=C(N1NC2C3=CC=CC=C3C4=CC=CC=C24)C

DOS

IR

Vibrations