Geometry & MOs

Info

ID:	147957
PubChem CID:	53787618
Reduced:	NO2C9H16 (2)
Stoich.:	AB2C9D16 (2)
Weight, g/mol:	123.104799
ΔH_f, kcal/mol:	-220.63
Dipole, Da:	4.5
IP(EA), eV:	-9.42(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethylhex-3-enenitrile

Drug info:

PubChemData

Smile

CC1(CCCCC1)OC(=O)N(C)N(C)C(=O)OC2(CCCCC2)C

DOS

IR

Vibrations