Geometry & MOs

Info

ID:	444306
PubChem CID:	135262014
Reduced:	ClO5N8C41H49 (1)
Stoich.:	AB5C8D41E49 (1)
Weight, g/mol:	136.053572
ΔH_f, kcal/mol:	-124.65
Dipole, Da:	7.52
IP(EA), eV:	-8.76(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbonic acid;1-fluoro-2-methylprop-1-ene

Drug info:

PubChemData

Smile

CC1(C(C(C1OC2=CC(=C(C=C2)C#N)Cl)(C)C)NC(=O)C3=CC=C(C=C3)N4CCC(CC4)CN5CCN(CC5)C6=CC(=O)N(N=C6)C7CCC(=O)NC7=O)C

DOS

IR

Vibrations