Geometry & MOs

Info

ID:	203717
PubChem CID:	79861797
Reduced:	NSC16H23 (1)
Stoich.:	ABC16D23 (1)
Weight, g/mol:	254.159455
ΔH_f, kcal/mol:	-1.91
Dipole, Da:	1.95
IP(EA), eV:	-8.59(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(difluoromethyl)-1-N-(2,2-dimethylcyclopentyl)benzene-1,4-diamine

Drug info:

PubChemData

Smile

CC1(CCCC1NC2CSCC3=CC=CC=C23)C

DOS

IR

Vibrations