Geometry & MOs

Info

ID:	47945
PubChem CID:	10535962
Reduced:	O3C11H18 (1)
Stoich.:	A3B11C18 (1)
Weight, g/mol:	198.115698
ΔH_f, kcal/mol:	-148.31
Dipole, Da:	3.57
IP(EA), eV:	-10.46(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-N-phenylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/C[C@@H]1CC[C@@H](C1)O

DOS

IR

Vibrations