Geometry & MOs

Info

ID:	297207
PubChem CID:	117612964
Reduced:	FO2N6C24H25 (1)
Stoich.:	AB2C6D24E25 (1)
Weight, g/mol:	146.097285
ΔH_f, kcal/mol:	-19.29
Dipole, Da:	8.13
IP(EA), eV:	-8.87(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-phosphanylcyclohexane-1,2-diamine

Drug info:

PubChemData

Smile

CC1(C2=C(C=C(C=C2)NC3=C4C(=CC=NC4=O)N(N3)[C@]5(CCCC[C@H]5F)CC#N)NC1=O)C

DOS

IR

Vibrations