Geometry & MOs

Info

ID:	233635
PubChem CID:	91146937
Reduced:	ON5C20H25 (1)
Stoich.:	AB5C20D25 (1)
Weight, g/mol:	182.178299
ΔH_f, kcal/mol:	53.11
Dipole, Da:	6.16
IP(EA), eV:	-8.15(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethane;2-N-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CCC1=C(N=C2C(=NC3=CC=C(C=C3)N(C)C)C(=C)NN2C1=O)C(C)C

DOS

IR

Vibrations